PHE CZ Chemical Shift Outliers

___________________________________________________
PHE CZ Chemical Shift Statistics
Chemical shifts
observed
Average
chemical shift
Minimum
chemical shift
Maximum
chemical shift
Standard
deviation
8505
129.002
7.351
165.611
4.252


Low-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
34216
117
PHE
CZ
165.611
.


High-field Shifts > Three Sigma from the Average Chemical Shift
Accession
number
Residue
number
Residue
type
Atom
name
Chemical
shift
Ambiguity
code
16057
37
PHE
CZ
113.6
1
16544
20
PHE
CZ
115.1
1
30221
34
PHE
CZ
115.659
1
26552
69
PHE
CZ
33.2299
.
34022
44
PHE
CZ
33.2299
.
26552
57
PHE
CZ
35.7499
.
34022
32
PHE
CZ
35.7499
.
6763
9
PHE
CZ
47.3
.
4150
68
PHE
CZ
50.82
.
6730
90
PHE
CZ
54.131
.
6730
28
PHE
CZ
54.136
.
4373
79
PHE
CZ
61.86
1
17073
42
PHE
CZ
67.83
1
16814
13
PHE
CZ
68.275
1
4368
19
PHE
CZ
69.4
1
20015
12
PHE
CZ
7.351
.
5179
35
PHE
CZ
71.42
.
25382
41
PHE
CZ
73.481
.
25382
30
PHE
CZ
74.035
.
25382
31
PHE
CZ
74.452
.
25382
54
PHE
CZ
75.563
.
5179
69
PHE
CZ
80.4
.
5179
32
PHE
CZ
82.02
.
6247
30
PHE
CZ
84.413
.
4368
31
PHE
CZ
87.1
1
4150
81
PHE
CZ
87.866
.
4368
60
PHE
CZ
88.4
1
34042
119
PHE
CZ
89.235
.
5897
87
PHE
CZ
9.281
1